| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 14 | No |
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | -0.11 | 4.13 | -52.75 | 2 | 7 | 1 | 89 | 199.19 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.11 | 2.43 | -16.08 | 1 | 7 | 0 | 85 | 198.182 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -0.11 | 4.61 | -99.64 | 3 | 7 | 2 | 91 | 200.198 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
